SANC01115 Lupeol acetate




Analog ID Similarity score SMILES

Selection options

Mcule | MolPort | All | None
MCULE-8513241513 1 C12(C)CCC3(C)CCC(C(=C)C)C3C1CCC1C3(C)CCC(OC(=O)C)C(C)(C)C3CCC21C
MolPort-038-386-682 1 CC(=O)O[C@H]1CC[C@@]2(C)C(CC[C@]3(C)C2CC[C@@H]2C4[C@@H](CC[C@]4(C)CC[C@@]32C)C(C)=C)C1(C)C
MolPort-002-524-982 1 CC(=O)O[C@@H]1CC[C@@]2(C)C(CC[C@]3(C)C2CC[C@@H]2C4[C@@H](CC[C@]4(C)CC[C@@]32C)C(C)=C)C1(C)C
MolPort-006-113-479 1 CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC[C@@H]2[C@H]4[C@@H](CC[C@]4(C)CC[C@@]32C)C(C)=C)C1(C)C
MolPort-007-980-898 1 CC(=O)OC1CC[C@@]2(C)C(CC[C@]3(C)C2CCC2C4C(CCC4(C)CC[C@@]32C)C(C)=C)C1(C)C
MCULE-4810585887 0.97 [C@@]12(C)CCC3(C(C(CC3)C(C)=C)C1CCC1[C@@]2(C)CCC2C1(C)CCC(OC(C)=O)C2(C)C)COC(C)=O
MCULE-3117538479 0.97 C(C)(=O)OC1CCC2(C)C3CCC4(C)C(CC=C)(O)CCC4C3CCC2(C1)[H]
MCULE-7424475004 0.97 C1C[C@@]2([C@@]3([H])CC[C@@]4([C@@]5([C@@](C)(CC[C@@]4(C)[C@]3(C)CC[C@@]2([H])C(C)([C@H]1OC(=O)C)C)CCC(=C)[C@H]5C)[H])[H])C
MCULE-2703659948 0.97 C1CC2(C)C(CCC(C)CCOC(=O)C)C(=C)CCC2C(C)(C)C1O
MolPort-020-005-943 0.97 C[C@H]1[C@@H]2[C@H]3CC[C@@H]4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@@]2(C)CCC1=C
MolPort-044-649-690 0.97 CC(=C)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12
MolPort-046-153-739 0.97 CC(=O)O[C@H]1CC[C@]2(C)[C@@H](CC[C@H]3C(=C)CC[C@H]4C(C)(C)[C@H](CC[C@]34C)OC(C)=O)C(=C)CC[C@H]2C1(C)C
MolPort-027-853-631 0.97 CC(CCOC(C)=O)CCC1C(=C)CCC2C(C)(C)C(O)CCC12C
MolPort-002-513-739 0.97 CC(=C)[C@@H]1CC[C@]2(CO)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)C5CC[C@@]34C)[C@H]12
MolPort-002-512-174 0.97 CC(=O)OCC12CC[C@H](C1C1CCC3[C@@]4(C)CCC(OC(C)=O)C(C)(C)C4CC[C@@]3(C)[C@]1(C)CC2)C(C)=C
MolPort-005-945-339 0.97 CC(=O)OC[C@]12CC[C@H]([C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(C)=C
MolPort-002-525-136 0.97 CC(=C)[C@@H]1CC[C@]2(COC(C)=O)CC[C@]3(C)C(CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)C12
MolPort-002-526-135 0.97 CC(=O)OC[C@]12CC[C@H]([C@H]1[C@H]1CCC3[C@@]4(C)CC[C@@H](OC(C)=O)C(C)(C)C4CC[C@@]3(C)[C@]1(C)CC2)C(C)=C
MolPort-002-526-374 0.97 CC(=C)[C@@H]1CC[C@]2(COC(C)=O)CC[C@]3(C)[C@H](CCC4[C@@]5(C)CC[C@@H](O)C(C)(C)C5CC[C@@]34C)C12
MolPort-007-980-814 0.97 CC(=C)C1CCC2(COC(C)=O)CC[C@]3(C)C(CCC4[C@@]5(C)CCC(O)C(C)(C)C5CC[C@@]34C)C12
MolPort-000-709-403 0.97 CC(=O)OCC12CCC(C1C1CCC3C4(C)CCC(OC(C)=O)C(C)(C)C4CC[C@@]3(C)[C@]1(C)CC2)C(C)=C
MolPort-002-530-001 0.97 CC(=C)[C@@H]1CC[C@]2(CO)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@@H](OC(C)=O)C(C)(C)C5CC[C@@]34C)C12
MolPort-007-980-813 0.97 CC(=C)C1CCC2(CO)CC[C@]3(C)C(CCC4[C@@]5(C)CCC(OC(C)=O)C(C)(C)C5CC[C@@]34C)C12
MolPort-044-649-691 0.97 CC(=C)[C@@H]1CC[C@]2(COC(C)=O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12
MCULE-8736730050 0.95 C(C)(=O)OC1CCC2(C)C(C1)(CCC1C3CCC(C3(C)CC(=C)C21)OC(C)=O)[H]
MCULE-8967153832 0.95 C(C)(=O)OC1CCC2(C)C3CC(C4(C)C(C=C)CCC4C3CCC2(C1)[H])OC(C)=O
MolPort-035-706-347 0.95 CC(C)C(=C)CC[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3CC[C@@H]4[C@]5(C[C@@]35CC[C@]12C)CC[C@H](OC(C)=O)C4(C)C
MCULE-3590471537 0.94 C=C(CCCCCCOC(C)=O)C
MCULE-3589037568 0.94 C=C(C)CCCCCOC(=O)C
MCULE-7392620730 0.94 C(CCOC(=O)C)CCCCC=C
MCULE-2561625191 0.94 C=CCCCCCCOC(C)=O
MolPort-023-213-012 0.94 CC(=O)OCCCCCCC=C
MolPort-023-213-018 0.94 CC(=C)CCCCCCOC(C)=O
MolPort-023-213-017 0.94 CC(=C)CCCCCOC(C)=O
MCULE-8764003404 0.92 C1(C(C)CCC(C(C)=C)C1)OC(C)=O
MCULE-4068704533 0.92 C=CCCC[C@@H]1[C@@H](OC(C)=O)C1
MolPort-039-338-095 0.92 CC(=C)C(O)CCC(=C)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]3CC[C@@]21C
MCULE-7198359038 0.91 C=CCCCCCOC(=O)C
MolPort-023-213-011 0.91 CC(=O)OCCCCCC=C
MCULE-7460548556 0.90 C(C)(=O)OC1CCC2(C)C3CCC4(C)C(=CC)CCC4C3CCC2(C1)[H]
MCULE-3989562438 0.90 C(C)(=O)OC1CCC2(C)C3CCC4(C)C(C=C)(CCC4C3CCC2(C1)[H])OC(C)=O
MCULE-6837878494 0.88 C12C(C(=C)C)CCC1(COC(=O)C)CCC1(C)C3(C)CCC4C(C)(C)C(CCC4(C)C3CCC21)=O
MolPort-042-644-764 0.88 CC(=O)OCC12CCC(C1C1CCC3[C@@]4(C)CCC(=O)C(C)(C)C4CC[C@@]3(C)[C@]1(C)CC2)C(C)=C
MolPort-002-526-756 0.88 CC(=O)O[C@@H]1CC[C@@]2(C)C(CC[C@]3(C)C2CC[C@@H]2C4[C@@H](CC[C@@]4(CC[C@@]32C)C=O)C(C)=C)C1(C)C
MolPort-002-524-287 0.88 CC(=O)OC[C@]12CC[C@H](C1[C@H]1CC[C@@H]3[C@@]4(C)CCC(=O)C(C)(C)C4CC[C@@]3(C)[C@]1(C)CC2)C(C)=C
MolPort-007-980-880 0.88 CC(=O)OCC12CC[C@H](C1C1CCC3[C@@]4(C)CCC(=O)C(C)(C)C4CC[C@@]3(C)[C@]1(C)CC2)C(C)=C
MCULE-2024187649 0.87 [C@]12(C)CCC[C@](C)(C(O)=O)C1CCC(=C)[C@@H]2CCC(C)CCOC(C)=O
MCULE-8055009685 0.87 C1(CC(CCC1C(C)=C)C)OC(C)=O
MolPort-001-742-533 0.87 CC(CCOC(C)=O)CC[C@H]1C(=C)CCC2[C@]1(C)CCC[C@]2(C)C(O)=O
MolPort-029-943-095 0.87 CC(CCC1C(=C)CCC2C(C)(COC(C)=O)CCCC12C)CC(O)=O
MolPort-007-980-901 0.86 CC(=C)C1CCC2(COC=O)CC[C@]3(C)C(CCC4[C@@]5(C)CCC(OC=O)C(C)(C)C5CC[C@@]34C)C12
MCULE-6886775784 0.85 [C@@]12(C)CCC3(C([C@H](C(C)=C)CC3)C1CCC1[C@@]2(C)CCC2[C@]1(C)CCC(OC(C)=O)C2(C)C)C(OC)=O
MCULE-8015641642 0.85 C1CC2(C)C3CCC4C5C(C(C)=C)CCC5(C(=O)O)CCC4(COC(=O)C)C3(C)CCC2C(C)(C)C1O
MCULE-8789756191 0.85 C12(C)C(=CCC)CCC1C1C(CC2)C2(C)CCC(CC2CC1)OC(C)=O
MCULE-1256663608 0.85 C1(=O)CC2(C)C(CCC(C)CCOC(=O)C)C(=C)CCC2C(C)(C)C1
MCULE-6145534296 0.85 C12(C)CCCC(C)(C)C1CCC(C)(OC(C)=O)C2CCC(C)(C=C)OC(C)=O
MCULE-6487078929 0.85 C1CC2(C)CCC(OC(=O)C)C(=C)C2CC1C(O)(C)C
MCULE-4832560741 0.85 C(C)=CCCCCCCCCOC(=O)C
MCULE-5828648964 0.85 C(C)(=O)OC(CCCCCCCC)C=C
MCULE-7718450791 0.85 CC(=O)OC(C=C)CCCCC
MolPort-002-801-253 0.85 COC(=O)C12CC[C@H](C1C1CCC3[C@@]4(C)CCC(OC(C)=O)C(C)(C)C4CC[C@@]3(C)[C@]1(C)CC2)C(C)=C
MolPort-007-980-881 0.85 CC(=C)[C@@H]1CCC2(CC[C@]3(C)C(CCC4[C@@]5(C)CCC(OC(C)=O)C(C)(C)C5CC[C@@]34C)C12)C(O)=O
MolPort-002-525-792 0.85 CC(=C)[C@@H]1CC[C@@]2(CC[C@]3(C)[C@H](CCC4[C@@]5(C)CC[C@@H](OC(C)=O)C(C)(C)C5CC[C@@]34C)C12)C(O)=O
MolPort-023-274-314 0.85 CC(=O)OC1CCC2(C)CCC(CC2C1=C)C(C)(C)O
MolPort-002-948-163 0.85 CC(=O)OC(C)(CCC1C(C)(CCC2C(C)(C)CCCC12C)OC(C)=O)C=C
MolPort-039-338-354 0.85 COC(=O)[C@]12CC[C@H]([C@@H]1[C@H]1CC[C@@H]3[C@@]4(C)CC[C@@H](OC(C)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(CO)CC2)C(C)=C
MolPort-038-386-613 0.85 CC(=C)C1CCC2(CCC3(COC(C)=O)C(CCC4C5(C)CCC(O)C(C)(C)C5CCC34C)C12)C(O)=O
MolPort-039-052-574 0.85 CC(C)=CCCC(=C)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]3CC[C@@]21C
MolPort-002-527-313 0.85 CC(=O)OC(C)(CC[C@H]1[C@@](C)(CC[C@H]2C(C)(C)CCC[C@]12C)OC(C)=O)C=C
MolPort-035-706-507 0.85 CC(=O)O[C@H]1C[C@@H](OC(C)=O)[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC[C@@H]2[C@H]4[C@@H](CC[C@]4(C)CC[C@@]32C)C(C)=C)C1(C)C
MolPort-003-960-143 0.85 CCCCCC(OC(C)=O)C=C
MolPort-035-683-181 0.85 CCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC[C@@H]2[C@H]4[C@@H](CC[C@]4(CO)CC[C@@]32C)C(C)=C)C1(C)C
MolPort-027-853-632 0.85 CC(CCOC(C)=O)CCC1C(=C)CCC2C(C)(C)CC(=O)CC12C
MCULE-9600703174 0.83 C(C)(=O)OC1CCC2(C)C3C=CC4(C)C(C(C)CCCOC(C)=O)CCC4C3CCC2(C1)[H]
MCULE-1245334026 0.83 C(C(=O)O)C[C@]1(C)[C@@]2([H])CC[C@@]3([C@@]([H])([C@@]4(CCC(=O)O4)C)CC[C@@]3(C)[C@]2(C)CC[C@@]1([H])C(=C)C)[H]
MCULE-5578038643 0.83 O(C1CCC2C1(C)CCC1C2CC=C2CCCCC21C)C(C)=O
MCULE-5705422004 0.83 C12(C)CC(COC(C)=O)C(CC1)C2(C)C
MCULE-9745404873 0.83 C(C)(=O)OC1CCC2(C)C3CCC4(C)C(C(C)CCC(CC)C(C)C)CCC4C3CCC2(C1)[H]
MCULE-1513200929 0.83 C(C)(=O)OC1CC2(C)C3CCC4(C)CCCC4C3CCC2(CC1)[H]
MCULE-5021705670 0.83 C12(C)CCC(CC1OC(C)=O)C2(C)C
MCULE-8131101043 0.83 C12(C)CCC3C(C)(CCC(O)C3C)C1CCC1C3C(COC(C)=O)(CCC3C(C)C)CCC12
MCULE-2231158911 0.83 C(C)(=O)OC1CC2(C)C(C(C)CCC(C)C(C)C)CCC2C2CCC3(CC(O)CCC3(C)C21)[H]
MCULE-5900421090 0.83 C12CCC(CC1(C)OC(=O)C)C2
MCULE-7067483839 0.83 C12(C)CCC3C(CCC4CC(CCC34C)OC(C)=O)C1CCC2OC(C)=O
MCULE-2767216043 0.83 C(C)(=O)OC1CC2(C)CCCC2C2CCC3(CCCCC3(C)C21)[H]
MCULE-2861050251 0.83 C(C)(=O)OC1CCCC2(C)C3CCC4(C)C(C(C)CCCC(C)C)CCC4C3CCC21[H]
MCULE-3174676232 0.83 [H]C12CCCCC1(C)C1CCC3(C)C(C(C)CCCC(C)C)CCC3C1C(C2)OC(C)=O
MCULE-5790008275 0.83 [H]C12CCCCC1(C)C1CCC3(C)CC(CC3C1CC2)OC(C)=O
MCULE-2287805891 0.83 C(C)(=O)OC1CCC2(C)C3CCC4(C)C(C(C)CCCC(C)C)CCC4C3CCC2(C1)[H]
MCULE-3462553161 0.83 C12(C)CCC(CC1CCC1C2CCC2(C1CCC2O)C)OC(C)=O
MCULE-5932819834 0.83 C(C)(=O)OC1CC2(CCC3C4CCC(C(O)C)C4(C)CCC3C2(C)CC1)[H]
MCULE-7694316868 0.83 C12CCC(CC1COC(C)=O)C2
MCULE-8784809700 0.83 [H]C12CCCCC1(C)C1CCC3(C)CCCC3C1C(C2)OC(C)=O
MCULE-3660876981 0.83 C12(C)CCC3C(CCC4([H])CCCCC34C)C1CCC2OC(C)=O
MCULE-1004817075 0.83 [C@]12(C)CC[C@@H](C[C@]1([H])CC[C@]1([H])[C@]2([H])CC[C@]2([C@@]1([H])CC[C@]2([H])CCO)C)OC(C)=O
MCULE-3948544707 0.83 [H]C12CCCCC1(C)C1CCC3(C)CCCC3C1CC2OC(C)=O
MCULE-1377445866 0.83 [H]C12CCCCC1(C)C1CCC3(C)C(CCC3C1CC2)C(C)(OC(C)=O)[H]
MCULE-1587870552 0.83 C(C)(=O)OC1CCC2(C)C(C1)(CCC1(C3CCC(C(C)CCC(C)C(C)C)C3(C)CC(O)C21)[H])[H]
MCULE-6356061416 0.83 C(C)(=O)OC1CCC2(C)C(C1)(CCC1C3CCC(C(C)CCC(C)C(C)C)C3(C)CC(C21[H])OC(C)=O)[H]
MCULE-7070503538 0.83 C(C)(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CCC2(C1)[H])C(C)([H])OC(C)=O
MCULE-7634586238 0.83 C1C2(CC(C(C)(C)C2OC(C)=O)C1)C
MCULE-4557996387 0.83 C1(C)(CCC(C)OC(C)=O)CC2CC1CC2
MCULE-8087271412 0.83 [H]C12CCCCC1(C)C1CC(C3(C)CCCC3C1CC2)OC(C)=O
MCULE-6138118781 0.83 C(C)(=O)OC1CCCC2(CCC3C4CCCC4(C)CCC3C21C)[H]
MCULE-6501662517 0.83 O(C1CC2CC1CC2)C(C)=O
MCULE-9619850136 0.83 O(C(C)=O)[C@H]1C[C@H]2CC[C@]1(C)C2(C)C
MCULE-5808049308 0.83 C(C)(=O)OC1CCC2(C)C(C1)(CCC1C3CCC(C(C)CCC(C)C(C)C)C3(C)CCC12[H])[H]
MCULE-9201347128 0.83 [C@@]12(C)CC[C@@H](C[C@H]1OC(C)=O)C2(C)C
MCULE-9568794332 0.83 [C@]12(C)CC[C@H](C[C@@H]1OC(C)=O)C2(C)C
MCULE-7087584399 0.83 C(OCCCCCCC)(CCCCCCCCC=C)=O
MolPort-006-110-796 0.83 CC(=O)O[C@H]1C[C@@H]2CC[C@@]1(C)C2(C)C
MolPort-002-319-520 0.83 CC(=O)OC1CCC2(C)C(CCC3C4CCC(O)C4(C)CCC23)C1
MolPort-044-755-193 0.83 CC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CCCC[C@]4(C)[C@H]3CC[C@]12C
MolPort-039-052-476 0.83 CC(=C)[C@@H]1CC[C@]2(C)[C@H](CC[C@@H]3[C@H](CC[C@@]23C)[C@]2(C)CCC(=O)O2)[C@@]1(C)CCC(O)=O
MolPort-046-762-876 0.83 CC(=O)O[C@@H]1C[C@@H]2CC[C@@]1(C)C2(C)C.CC(=O)O[C@H]1C[C@@H]2CC[C@@]1(C)C2(C)C
MolPort-046-683-464 0.83 C.CC(=O)O[C@@H]1C[C@@H]2CC[C@@]1(C)C2(C)C
MolPort-046-195-337 0.83 CC(=O)O[C@@H]1C[C@H]2CC[C@]1(C)C2(C)C
MolPort-044-755-240 0.83 CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(C)=O
MolPort-002-558-190 0.83 CC(CCC1(C)CC2CCC1C2)OC(C)=O
MolPort-000-480-345 0.83 CC(=O)OC1CCC2C3CCC4CC(CCC4(C)C3CCC12C)OC(C)=O
MolPort-006-110-216 0.83 CC(=O)O[C@@H]1C[C@@H]2CC[C@@]1(C)C2(C)C
MolPort-000-743-453 0.83 CC(=O)OC1CC2CCC1(C)C2(C)C
MolPort-002-507-826 0.83 CC(=O)OCC1CC2CCC1C2
MCULE-2538735041 0.82 C(OCCC(C)CC/C=C(\C)/C)(C)=O
MolPort-001-815-959 0.82 CC(CCOC(C)=O)CCC=C(C)C
MCULE-8296033831 0.81 C(C)(=O)OC1CCC2(C)C(C1)(C(CC1C3CCC(C(C)C=CC(C)C(C)C)C3(C)CCC12[H])OC(C)=O)[H]
MCULE-6934635209 0.81 C1C[C@]2(C)[C@@]3([H])CC[C@]4([C@]5([H])CC(C)(C)CC[C@@]5(CC=C4[C@]3(C)CC[C@@]2([H])C([C@H]1OC(=O)C)(C)C)C)C
MCULE-5167372567 0.81 C(C)(=O)OC1CCC2(C)C3CCC4(C)CCCC4C3C(O)CC2(C1)[H]
MCULE-2057274556 0.81 C(C)(=O)OC1CCC2(C)C3C(CC4(C)CC(CC4C3CCC2(C1)[H])OC(C)=O)OC(C)=O
MCULE-5559314914 0.81 CC(OCC1(C2(C)C3C2CC1C3)C)=O
MCULE-6819389160 0.81 CC(=O)O[C@@]1(C)[C@@]23CC[C@@H](C)[C@@H](C2)C(C)(C)[C@]3([H])CC1
MCULE-9186821522 0.81 C(C)(=O)OC1CCC2(C)C3C(O)(C)CC4(C)C(CCC4C3CCC2(C1)[H])C(C)([H])OC(C)=O
MCULE-7418191482 0.81 [C@]12(C)CC[C@H](C[C@@]1([H])[C@@H](O)C[C@@]1([H])C3[C@@](C)([C@H](CC3)OC(C)=O)CCC12)O
MCULE-1167985014 0.81 CC(=O)O[C@@]1(C)[C@@]23CC[C@@H](C)[C@@H](C2)C(C)(C)[C@]3([H])CC1
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